1-(2-chlorophenyl)ethanamine - CAS 39959-67-6
Catalog: |
BB024218 |
Product Name: |
1-(2-chlorophenyl)ethanamine |
CAS: |
39959-67-6 |
Synonyms: |
1-(2-chlorophenyl)ethanamine; 1-(2-chlorophenyl)ethanamine |
IUPAC Name: | 1-(2-chlorophenyl)ethanamine |
Description: | 1-(2-chlorophenyl)ethanamine (CAS# 39959-67-6) is a useful research chemical. |
Molecular Weight: | 155.62 |
Molecular Formula: | C8H10ClN |
Canonical SMILES: | CC(C1=CC=CC=C1Cl)N |
InChI: | InChI=1S/C8H10ClN/c1-6(10)7-4-2-3-5-8(7)9/h2-6H,10H2,1H3 |
InChI Key: | RJPLGQTZHLRZGX-UHFFFAOYSA-N |
Boiling Point: | 217.4 ℃ at 760 mmHg |
Purity: | 95 % |
Density: | 1.122 g/cm3 |
MDL: | MFCD05215230 |
LogP: | 3.06000 |
GHS Hazard Statement: | H314 (66.67%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021064189-A2 | Prostaglandin e2 (pge2) ep4 receptor antagonists | 20191002 |
US-2020347009-A1 | Bicyclic compounds | 20190416 |
WO-2020214734-A1 | Bicyclic compounds | 20190416 |
WO-2020102686-A1 | Erk inhibitors and uses thereof | 20181116 |
CN-113302175-A | Bicyclic compounds | 20181109 |
Complexity: | 105 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.0501770 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.0501770 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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